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Product Information
Chemical Data
Analyte Name
(R)-5-Chloro-alpha-(cyclopropylethynyl)-2-amino-alpha-(trifluoromethyl) benzenemethanol
CAS Number
927812-33-7
Molecular Formula
C13 H11 Cl F3 N O
Molecular Weight
289.68
Accurate Mass
289.0481
SMILES
Nc1ccc(Cl)cc1[C@](O)(C#CC2CC2)C(F)(F)F
InChI
InChI=1S/C13H11ClF3NO/c14-9-3-4-11(18)10(7-9)12(19,13(15,16)17)6-5-8-1-2-8/h3-4,7-8,19H,1-2,18H2/t12-/m1/s1
IUPAC
(2R)-2-(2-amino-5-chlorophenyl)-4-cyclopropyl-1,1,1-trifluorobut-3-yn-2-ol
Product Data
Storage Temperature
-20°C
Shipping Temperature
Room Temperature
Country of Origin
CANADA
Product Type
Impurity
Product Format
Neat
API Family
Product Description
Efavirenz (E425000) impurity.
References: Young, S., et al.: Antimicrob. Agents Chemother., 39, 2602